Methyl N-(4-{[(8Xi,9Xi,12α,14Xi)-3,20-Dioxopregn-4-En-12-Yl]Oxy}-4-Oxobutanoyl)-L-Tyrosinate
Properties
| Property | Value |
|---|---|
| Formula | C35H45NO8 |
| IUPAC Name | [(8r,9s,10r,12s,13s,14r,17s)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-12-yl] 4-[[(1s)-1-[(4-hydroxyphenyl)methyl]-2-methoxy-2-oxo-ethyl]amino]-4-oxo-butanoate |
| Molecular Mass | 607.734 g·mol−1 |
| Heat of Formation | -1584.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.81 ± 1.08 D |
| Volume | 737.02 Å 3 |
| Surface Area | 471.06 Å 2 |
| HOMO Energy | -8.64 ± 0.55 eV |
| LUMO Energy | 2.87 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QDRIHLHORYETQU-IAEPVCBFSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |